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1020719-30-5 | 1H-Imidazo[4,5-b]pyridine, 2-chloro-1-(methyl-d3)-6-phenyl-
CAS No: 1020719-30-5 Catalog No: AG0006JO MDL No:
Product Description
Catalog Number:
AG0006JO
Chemical Name:
1H-Imidazo[4,5-b]pyridine, 2-chloro-1-(methyl-d3)-6-phenyl-
CAS Number:
1020719-30-5
Molecular Formula:
C13H7ClD3N3
Molecular Weight:
246.7101
IUPAC Name:
2-chloro-6-phenyl-1-(trideuteriomethyl)imidazo[4,5-b]pyridine
InChI:
InChI=1S/C13H10ClN3/c1-17-11-7-10(9-5-3-2-4-6-9)8-15-12(11)16-13(17)14/h2-8H,1H3/i1D3
InChI Key:
FBFVKWMIRFROSV-FIBGUPNXSA-N
SMILES:
Clc1nc2c(n1C([2H])([2H])[2H])cc(cn2)c1ccccc1
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.075g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
3
Molecular Weight:
246.712g/mol
Monoisotopic Mass:
246.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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